Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | F2 | P00734 | 1/20 | 0.43 |
| ▸ | F7 | P08709 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | CASP6 | P55212 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | F10 | P00742 | 2/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5900692 | 0.89 | F2 (0.47) | KMT2AGAAF2F7MEN1 | |
| SCHEMBL8266398 | 0.88 | F2 (0.44) | F2F7L3MBTL1CA1CA2 | |
| Hydrochloric Acid SCHEMBL5089175 | 0.87 | F2 (0.43) | F2F7L3MBTL1CA1CA2 | |
| SCHEMBL5564415 | 0.85 | CA1 (0.44) | KMT2AF2F7MEN1CA1 | |
| SCHEMBL8266155 | 0.83 | CA1 (0.42) | F2F7CA1CA2F10 | |
| SCHEMBL8267082 | 0.82 | HDAC8 (0.53) | ALDH1A1HPGDHDAC1F2CA1 | |
| SCHEMBL8264827 | 0.82 | NPC1 (0.47) | ALDH1A1KMT2ATP53HDAC3HDAC1 | |
| SCHEMBL5178502 | 0.82 | CA1 (0.41) | ALDH1A1TP53GAAKDM4EF2 | |
| Hydrochloric Acid SCHEMBL5086284 | 0.82 | CA1 (0.41) | F2F7CA1CA2F10 | |
| Hydrochloric Acid SCHEMBL5094118 | 0.82 | HDAC8 (0.52) | ALDH1A1HPGDHDAC1F2CA1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2006027135-A1 | 4-AMINOMETHYL BENZAMIDINE DERIVATIVES AND THEIR USE AS FACTOR VIIIA INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2006-03-16 | — | — | WO | disclosed |